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332976

4-Propylbenzoic acid

Name: 4-Propylbenzoic acid
Brand: ALDRICH

97%

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About This Item

Linear Formula:

CH₃CH₂CH₂C₆H₄CO₂H

CAS Number:

2438-05-3

Molecular Weight:

164.20

NACRES:

NA.22

PubChem Substance ID:

24860093

UNSPSC Code:

12352100

MDL number:

MFCD00013996

Assay:

97%

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Properties

assay

97%

mp

142-144 °C (lit.)

functional group

carboxylic acid

SMILES string

CCCc1ccc(cc1)C(O)=O

InChI

1S/C10H12O2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,2-3H2,1H3,(H,11,12)

InChI key

ATZHGRNFEFVDDJ-UHFFFAOYSA-N

Description

Application

4-Propylbenzoic acid was used in the preparation of [2,7-dimethoxy-8-(4-propylbenzoyl)naphthalen-1-yl](4-propylphenyl)-methanone.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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[2,7-Dimeth-oxy-8-(4-propyl-benzo-yl)naphthalen-1-yl](4-propyl-phen-yl)methanone.

Kosuke Sasagawa et al.

Acta crystallographica. Section E, Structure reports online, 68(Pt 8), o2596-o2596 (2012-08-21)

In the title compound, C(32)H(32)O(4), the 4-propyl-benzoyl groups at the 1- and 8-positions of the naphthalene ring system are aligned almost anti-parallel, and their benzene rings make a dihedral angle of 8.64 (10)°. The dihedral angles between the naphthalene ring system

Global Trade Item Number

SKU	GTIN
332976-1G	04061825591353